CID 71757035

(1-cyclopropylcyclopropyl)methanamine hydrochloride

Structural Information

Molecular Formula

C₇H₁₃N

SMILES

C1CC1C2(CC2)CN

InChI

InChI=1S/C7H13N/c8-5-7(3-4-7)6-1-2-6/h6H,1-5,8H2

InChIKey

BLOQUSDJULIXQE-UHFFFAOYSA-N

Compound name

(1-cyclopropylcyclopropyl)methanamine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 1
Patents: 111.1048 Da
Monoisotopic Mass: 1.0
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]+	112.112076	132.4
[M+Na]+	134.094018	139.7
[M-H]-	110.097524	139.5
[M+NH4]+	129.138623	144.6
[M+K]+	150.067958	139.8
[M+H-H2O]+	94.102060	127.9
[M+HCOO]-	156.103001	153.2
[M+CH3COO]-	170.118651	185.3
[M+Na-2H]-	132.079466	138.0
[M]+	111.10425142	134.2
[M]-	111.10534858	134.2

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe