CID 19041828

4-cyclopropylbutan-1-amine

Structural Information

Molecular Formula
C7H15N
SMILES
C1CC1CCCCN
InChI
InChI=1S/C7H15N/c8-6-2-1-3-7-4-5-7/h7H,1-6,8H2
InChIKey
JBVMHCMMNNUPMK-UHFFFAOYSA-N
Compound name
4-cyclopropylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

271
Patents

113.12045 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 114.12773 123.6
[M+Na]+ 136.10967 131.6
[M-H]- 112.11317 127.7
[M+NH4]+ 131.15427 141.1
[M+K]+ 152.08361 129.6
[M+H-H2O]+ 96.117710 117.8
[M+HCOO]- 158.11865 148.0
[M+CH3COO]- 172.13430 176.4
[M+Na-2H]- 134.09512 130.3
[M]+ 113.11990 124.7
[M]- 113.12100 124.7
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe