CID 4771131

229003-16-1

Structural Information

Molecular Formula

C₄H₉N₅

SMILES

CC(C)N1N=C(N=N1)N

InChI

InChI=1S/C4H9N5/c1-3(2)9-7-4(5)6-8-9/h3H,1-2H3,(H2,5,7)

InChIKey

NEJVMYROZIQXMS-UHFFFAOYSA-N

Compound name

2-propan-2-yltetrazol-5-amine

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 31
Patents: 127.08579 Da
Monoisotopic Mass: 0.5
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]+	128.09307	124.5
[M+Na]+	150.07501	134.9
[M+NH4]+	145.11961	131.0
[M+K]+	166.04895	133.0
[M-H]-	126.07851	123.5
[M+Na-2H]-	148.06046	129.4
[M]+	127.08524	125.3
[M]-	127.08634	125.3

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe