CID 123670245

4-(2-methylcyclopropyl)butan-1-amine

Structural Information

Molecular Formula
C8H17N
SMILES
CC1CC1CCCCN
InChI
InChI=1S/C8H17N/c1-7-6-8(7)4-2-3-5-9/h7-8H,2-6,9H2,1H3
InChIKey
YEBRZXZMOCCDMT-UHFFFAOYSA-N
Compound name
4-(2-methylcyclopropyl)butan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

127.1361 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 128.143376 127.5
[M+Na]+ 150.125318 136.0
[M-H]- 126.128824 131.8
[M+NH4]+ 145.169923 144.8
[M+K]+ 166.099258 133.6
[M+H-H2O]+ 110.133360 121.8
[M+HCOO]- 172.134301 151.5
[M+CH3COO]- 186.149951 180.3
[M+Na-2H]- 148.110766 133.0
[M]+ 127.13555142 129.4
[M]- 127.13664858 129.4
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