CID 155971007

(1-methoxyprop-2-yn-1-yl)cyclopentane

Structural Information

Molecular Formula
C9H14O
SMILES
COC(C#C)C1CCCC1
InChI
InChI=1S/C9H14O/c1-3-9(10-2)8-6-4-5-7-8/h1,8-9H,4-7H2,2H3
InChIKey
RVJQJNAKJLEZQQ-UHFFFAOYSA-N
Compound name
1-methoxyprop-2-ynylcyclopentane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

138.10446 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.11174 131.2
[M+Na]+ 161.09368 140.8
[M+NH4]+ 156.13828 136.5
[M+K]+ 177.06762 133.6
[M-H]- 137.09718 124.5
[M+Na-2H]- 159.07913 132.8
[M]+ 138.10391 129.7
[M]- 138.10501 129.7
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

No patent data available for this compound.