CID 18856

N-(1-adamantyl)formamide

Structural Information

Molecular Formula
C11H17NO
SMILES
C1C2CC3CC1CC(C2)(C3)NC=O
InChI
InChI=1S/C11H17NO/c13-7-12-11-4-8-1-9(5-11)3-10(2-8)6-11/h7-10H,1-6H2,(H,12,13)
InChIKey
BUPHJFOIWZKPNV-UHFFFAOYSA-N
Compound name
N-(1-adamantyl)formamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

2
References

221
Patents

179.13101 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 180.13829 139.6
[M+Na]+ 202.12023 148.5
[M+NH4]+ 197.16483 152.8
[M+K]+ 218.09417 138.8
[M-H]- 178.12373 138.4
[M+Na-2H]- 200.10568 137.7
[M]+ 179.13046 140.5
[M]- 179.13156 140.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe