CID 16771607

N-(3-methylbutyl)cyclopropanamine hydrochloride

Structural Information

Molecular Formula

C₈H₁₇N

SMILES

CC(C)CCNC1CC1

InChI

InChI=1S/C8H17N/c1-7(2)5-6-9-8-3-4-8/h7-9H,3-6H2,1-2H3

InChIKey

DFCGUBWPNVTPFC-UHFFFAOYSA-N

Compound name

N-(3-methylbutyl)cyclopropanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 17
Patents: 127.1361 Da
Monoisotopic Mass: 2.0
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]+	128.14338	127.5
[M+Na]+	150.12532	138.7
[M+NH4]+	145.16992	136.9
[M+K]+	166.09926	134.3
[M-H]-	126.12882	136.3
[M+Na-2H]-	148.11077	135.5
[M]+	127.13555	132.5
[M]-	127.13665	132.5

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe