malic_acid bmse000046 C4H6O5 LINE POINT HZ PPM INTENSITY REL_INT LABEL 1 5181 23104.31 183.828 100547032 44.337 1 2 5351 22949.56 182.597 106768824 47.080 2 3 20502 9188.29 73.106 237833280 104.874 3 4 24339 5703.26 45.378 238418480 105.132 4