CID 3918674

1-(2-methyl-5-nitrophenyl)hydrazine

Structural Information

Molecular Formula

C₇H₉N₃O₂

SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])NN

InChI

InChI=1S/C7H9N3O2/c1-5-2-3-6(10(11)12)4-7(5)9-8/h2-4,9H,8H2,1H3

InChIKey

ZMHHLAAPJJAADE-UHFFFAOYSA-N

Compound name

(2-methyl-5-nitrophenyl)hydrazine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 7
Patents: 167.06947 Da
Monoisotopic Mass: 1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	168.07675	131.1
[M+Na]+	190.05869	143.0
[M+NH4]+	185.10329	139.3
[M+K]+	206.03263	140.3
[M-H]-	166.06219	135.4
[M+Na-2H]-	188.04414	137.7
[M]+	167.06892	133.7
[M]-	167.07002	133.7

Literature stripe

literature stripe

Patent stripe

patents stripe